HRID1231358

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID16028

Tetrabutylammonium

C16H36N+

HCID19660

Carbonate

CO3-2

HCID30165

Iodide ion

I-

HCID69632

Bromoacetamide

C2H4BrNO

HCID104967

Cesium(1+)

Cs+

2 次

结构：CCCNn1c(=O)c(C2=NS(=O)(=O)c3cc(O)ccc3N2)c(O)c2ccccc21

HCID136358417

未命名化合物

PRODUCTS

生成物

结构：CCCNn1c(=O)c(C2=NS(=O)(=O)c3cc(OCC(N)=O)ccc3N2)c(O)c2ccccc21

HCID136347380

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-346556024e08436883a6b09af1f27632
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[Br:36][CH2:37][C:38](=[O:39])[NH2:40].[C:30](=[O:31])([O-:32])[O-:33].[CH2:47]([N+:48]([CH2:49][CH2:50][CH2:51][CH3:52])([CH2:53][CH2:54][CH2:55][CH3:56])[CH2:57][CH2:58][CH2:59][CH3:60])[CH2:61][CH2:62][CH3:63].[CH3:41][N:42]([CH3:43])[CH:44]=[O:45].[Cs+:34].[Cs+:35].[I-:46].[OH:1][c:2]1[c:3]([C:17]2=[N:18][S:19](=[O:28])(=[O:29])[c:20]3[c:21]([cH:23][cH:24][c:25]([OH:27])[cH:26]3)[NH:22]2)[c:4](=[O:16])[n:5]([NH:12][CH2:13][CH2:14][CH3:15])[c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]12>>[OH:1][c:2]1[c:3]([C:17]2=[N:18][S:19](=[O:28])(=[O:29])[c:20]3[c:21]([cH:23][cH:24][c:25]([O:27][CH2:37][C:38](=[O:39])[NH2:40])[cH:26]3)[NH:22]2)[c:4](=[O:16])[n:5]([NH:12][CH2:13][CH2:14][CH3:15])[c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]12